3-Pyridinamine, N-(4-methylphenyl)-
Basic information
- CAS
285991-95-9- Standard SMILES
Cc1ccc(Nc2cccnc2)cc1- InChIKey
VSMARCBHVFVKKN-UHFFFAOYSA-N- Molecular formula
- C12H12N2
- Average molar mass
- 184.24 g/mol
- Monoisotopic mass
- 184.10004839
Names & identifiers
- Preferred name
- 3-Pyridinamine, N-(4-methylphenyl)-
- IUPAC
- N-(4-methylphenyl)pyridin-3-amine
- English name
- 3-Pyridinamine, N-(4-methylphenyl)-
- Molecular formula
- C12H12N2
- Molecular weight
- 184.24
Names & synonyms
285991-95-9N-(p-Tolyl)pyridin-3-amineN-(4-methylphenyl)pyridin-3-amine3-Pyridinamine, N-(4-methylphenyl)-Pyridine, 3-(4-tolylamino)-SCHEMBL6431980DTXSID90345311VSMARCBHVFVKKN-UHFFFAOYSA-NN-(4-Methylphenyl)-3-pyridinamineMFCD00507026AKOS006271681N-(4-Methylphenyl)-3-pyridinamine #
Show more names
F93888
Database identifiers
- CAS
285991-95-9- PubChem CID
- 603589
- DTXSID
DTXSID90345311- Nikkaji
- J1.299.030H
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 24.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 162
Physicochemical properties
- Melting point
- 414 · 414-415 °C
- Boiling point
- 342.6 · 342.6±17.0 °C(Predicted)
- Density
- 1.116 · 1.116±0.06 g/cm3(Predicted)
- pka
- 5.6 · 5.60±0.11(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Related reactions
863 records
Compound notes
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